SCHEMBL2086299-75-2
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SCHEMBL2086299-75-2
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CAS No:
2086299-75-2
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Formula:
C51H64ClN9O8S2
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Chemical Name:
SCHEMBL2086299-75-2
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Synonyms:
SCHEMBL22419103;(2S,4R)-1-((S)-2-(tert-Butyl)-19-((S)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl)-4,18-dioxo-6,9,12-trioxa-3,17-diazanonadecanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide;2086299-75-2
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CAS No:
Computed Properties
Molecular Weight:1030.7
XLogP3:5.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:23
Exact Mass:1029.4007801
Monoisotopic Mass:1029.4007801
Topological Polar Surface Area:268
Heavy Atom Count:71
Complexity:1790
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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